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Issue Date | Title | Author(s) |
---|---|---|
2003 | Electronic structure of a neutral oxygen vacancy in SrTiO3 | Ricci, Davide; Bano, Giuseppe; Pacchioni, Gianfranco; Illas i Riera, Francesc |
2004 | Electronic and magnetic structure of LaMnO3 from hybrid periodic density-functional theory | Muñoz Ramos, David; Harrison, N. M.; Illas i Riera, Francesc |
2004 | MgO/Ag(001) interface structure and STM images from first principles | López, Núria (López Alonso); Valeri, S. |
2004 | Theoretical modeling of photon and electron-stimulated Na and K desorption from SiO2 | Domínguez-Ariza, David; López, Núria (López Alonso); Illas i Riera, Francesc; Pacchioni, Gianfranco; Madey, Theodore E. |
2004 | Ab initio study of the charge order and Zener polaron formation in half-doped manganites | Graaf, Coen de; Sousa Romero, Carmen; Broer, Ria |
2002 | First-principles study of the neutral molecular metal Ni(tmdt)2. | Rovira i Virgili, Carme; Novoa Vide, Juan J.; Mozos Liz, José Luis de los; Ordejón, Pablo; Canadell, Enric, 1950- |
2003 | Ab initio periodic approach to electronic structure and magnetic exchange in A2CUO2X2 (A=Ca,Sr and X=F,Cl) High-Tc superconductor parent compounds | Moreira, Ibério de Pinho Ribeiro; Dovesi, R. |
2000 | Ab initio study of MF2 (M=Mn, Fe, Co, Ni) rutile-type compounds using the periodic unrestricted Hartree-Fock approach | Moreira, Ibério de Pinho Ribeiro; Dovesi, R.; Roetti, C.; Saunders, Víctor R.; Orlando, Roberto |
2003 | Charge and Zener polaron order in Bi0.75Sr0.25MnO3 | Frontera Beccaria, Carlos; García Muñoz, José Luis; Aranda, Miguel A. G.; Hervieu, Maryvonne; Ritter, Clemens; Mañosa, Lluís; Garcia Capdevila, Xavier; Calleja Lázaro, Alberto |
2007 | Reversible ferromagnetic switching in ZnO:(Co,Mn) powders | Rubí, D.; Fontcuberta i Griñó, Josep; Calleja Lázaro, Alberto; Aragonès, Ll.; Garcia Capdevila, Xavier; Segarra Rubí, Mercè |
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